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(2S)-(-)-2,5-DIHYDRO-4-METHYL-5-OXO-2-PENTYL-3-FURANCARBOXYLIC-ACID-METHYLESTER
SpectraBase Compound ID ABonSjM3D9m
InChI InChI=1S/C12H18O4/c1-4-5-6-7-9-10(12(14)15-3)8(2)11(13)16-9/h9H,4-7H2,1-3H3/t9-/m0/s1
InChIKey SATULRKSMGYLJY-VIFPVBQESA-N
Mol Weight 226.27 g/mol
Molecular Formula C12H18O4
Exact Mass 226.120509 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5CiF2CGJQ6p
Name (2S)-2-amyl-5-keto-4-methyl-2H-furan-3-carboxylic acid methyl ester
Alternate Name(s) (2S)-4-methyl-5-oxo-2-pentyl-2H-furan-3-carboxylic acid methyl ester Methyl (2S)-4-methyl-5-oxidanylidene-2-pentyl-2H-furan-3-carboxylate Methyl (2S)-4-methyl-5-oxo-2-pentyl-2H-furan-3-carboxylate
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Formula C12H18O4
InChI InChI=1S/C12H18O4/c1-4-5-6-7-9-10(12(14)15-3)8(2)11(13)16-9/h9H,4-7H2,1-3H3/t9-/m0/s1
InChIKey SATULRKSMGYLJY-VIFPVBQESA-N
Molecular Weight 226.272 g/mol
SMILES C1(=C(C(=O)O[C@]1(CCCCC)[H])C)C(=O)OC
SPLASH splash10-05i4-5900000000-246399388b881708260b
Source of Spectrum J-63-2388-3
Wiley ID 1227374